2-(2-methyltridecan-2-ylazaniumyl)butanoate

Systemtic Name: 2-(2-methyltridecan-2-ylazaniumyl)butanoate Openeye Name: 2-(1,1-dimethyldodecylammonio)butanoate CAS Name: 2-(2-methyltridecan-2-ylammonio)butanoate IUPAC Name: 2-(2-methyltridecan-2-ylazaniumyl)butanoate Traditional Name: 2-(1,1-dimethyldodecylammonio)butyrate Formula: C18H37NO2 MolecularWeight: 299.49188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)(C)[NH2+]C(CC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(C)(C)[NH2+]C(CC)C(=O)[O-]

InChI

InChI=1S/C18H37NO2/c1-5-7-8-9-10-11-12-13-14-15-18(3,4)19-16(6-2)17(20)21/h16,19H,5-15H2,1-4H3,(H,20,21)